N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(propan-2-ylsulfamoyl)benzamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(propan-2-ylsulfamoyl)benzamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(isopropylsulfamoyl)benzamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-4-(propan-2-ylsulfamoyl)benzamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-4-(propan-2-ylsulfamoyl)benzamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-4-(isopropylsulfamoyl)benzamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC(C)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)NC(C)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H31N3O5S2/c1-17(2)25-32(28,29)21-12-9-19(10-13-21)23(27)24-20-11-8-18(3)22(16-20)33(30,31)26-14-6-4-5-7-15-26/h8-13,16-17,25H,4-7,14-15H2,1-3H3,(H,24,27)